ethyl 4-(diethoxymethyl)-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(diethoxymethyl)-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(diethoxymethyl)-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-(diethoxymethyl)-6-(3-nitrophenyl)-2-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(diethoxymethyl)-6-(3-nitrophenyl)-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-(diethoxymethyl)-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C24H25N3O6 MolecularWeight: 451.4718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=NC(=NC(=C1C(=O)OCC)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3)OCC

Isomeric SMILES

CCOC(C1=NC(=NC(=C1C(=O)OCC)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3)OCC

InChI

InChI=1S/C24H25N3O6/c1-4-31-23(28)19-20(17-13-10-14-18(15-17)27(29)30)25-22(16-11-8-7-9-12-16)26-21(19)24(32-5-2)33-6-3/h7-15,24H,4-6H2,1-3H3